Please use this identifier to cite or link to this item: https://hdl.handle.net/11147/5997
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dc.contributor.authorMoğulkoç, Yeşim-
dc.contributor.authorModarresi, Mohsen-
dc.contributor.authorMoğulkoç, Aybey-
dc.contributor.authorÇiftci, Yasemin-
dc.date.accessioned2017-07-24T07:35:42Z-
dc.date.available2017-07-24T07:35:42Z-
dc.date.issued2016-11-01-
dc.identifier.citationMoğulkoç, Y., Modarresi, M., Moğulkoç, A., and Çiftci, Y. (2016). Electronic and optical properties of bilayer blue phosphorus. Computational Materials Science, 124, 23-29. doi:10.1016/j.commatsci.2016.07.015en_US
dc.identifier.issn0927-0256-
dc.identifier.urihttp://doi.org/10.1016/j.commatsci.2016.07.015-
dc.identifier.urihttp://hdl.handle.net/11147/5997-
dc.description.abstractWe investigate the electronic and optical properties of monolayer and stacking dependent bilayer blue phosphorus in the framework of density functional theory (DFT) and tight-binding approximations. We extract the hopping parameters of TB Hamiltonian for monolayer and bilayer blue phosphorus by using the DFT results. The variation of energy band gap with applied external electric field for two different stacks of bilayer blue phosphorus are also shown. We examine the linear response of the systems due to the external electromagnetic radiation in terms of the dielectric functions in the DFT theory. The relatively large electronic band gap and possibility of exfoliation form bulk structure due to weak interlayer coupling, make blue phosphorus an appropriate candidate for future electronic devices.en_US
dc.language.isoenen_US
dc.publisherElsevier Ltd.en_US
dc.relation.ispartofComputational Materials Scienceen_US
dc.rightsinfo:eu-repo/semantics/openAccessen_US
dc.subjectBlue phosphorusen_US
dc.subjectDensity functional theoryen_US
dc.subjectOptical propertiesen_US
dc.subjectTight-bindingen_US
dc.subjectBinding energyen_US
dc.titleElectronic and optical properties of bilayer blue phosphorusen_US
dc.typeArticleen_US
dc.institutionauthorModarresi, Mohsen-
dc.departmentIzmir Institute of Technology. Physicsen_US
dc.identifier.volume124en_US
dc.identifier.startpage23en_US
dc.identifier.endpage29en_US
dc.identifier.wosWOS:000383827500004en_US
dc.identifier.scopus2-s2.0-84979240848en_US
dc.relation.publicationcategoryMakale - Uluslararası Hakemli Dergi - Kurum Öğretim Elemanıen_US
dc.identifier.doi10.1016/j.commatsci.2016.07.015-
dc.relation.doi10.1016/j.commatsci.2016.07.015en_US
dc.coverage.doi10.1016/j.commatsci.2016.07.015en_US
dc.identifier.scopusqualityQ1-
item.fulltextWith Fulltext-
item.openairetypeArticle-
item.cerifentitytypePublications-
item.languageiso639-1en-
item.openairecristypehttp://purl.org/coar/resource_type/c_18cf-
item.grantfulltextopen-
Appears in Collections:Physics / Fizik
Scopus İndeksli Yayınlar Koleksiyonu / Scopus Indexed Publications Collection
WoS İndeksli Yayınlar Koleksiyonu / WoS Indexed Publications Collection
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